Cas no 2762-36-9 (4-Pyrimidinecarboxylicacid, 2-amino-1,6-dihydro-5-methyl-6-oxo-)

4-Pyrimidinecarboxylicacid, 2-amino-1,6-dihydro-5-methyl-6-oxo- structure
2762-36-9 structure
Product Name:4-Pyrimidinecarboxylicacid, 2-amino-1,6-dihydro-5-methyl-6-oxo-
CAS No:2762-36-9
MF:C6H7N3O3
MW:169.138080835342
CID:291238
PubChem ID:135538388
Update Time:2025-04-19

4-Pyrimidinecarboxylicacid, 2-amino-1,6-dihydro-5-methyl-6-oxo- Chemical and Physical Properties

Names and Identifiers

    • 4-Pyrimidinecarboxylicacid, 2-amino-1,6-dihydro-5-methyl-6-oxo-
    • 2-amino-5-methyl-4-oxo-1H-pyrimidine-6-carboxylic acid
    • 2-amino-5-methyl-6-oxo-1,6-dihydro-pyrimidine-4-carboxylic acid
    • 2-amino-6-oxo-5-(4-phenyl-butyl)-1,6-dihydro-pyrimidine-4-carboxylic acid
    • 4-Hydroxy-2-amino-6-carboxy-5-(4-phenylbutyl)-pyrimidin
    • 4-Hydroxy-2-amino-6-carboxy-5-methylpyrimidin
    • 4-Pyrimidinecarboxylicacid, 2-amino-1,6-dihydro-6-oxo-5-(4-phenylbutyl)-
    • 5-Methyl-6-hydroxy-2-amino-4-carboxypyrimidin
    • AC1L7FHV
    • CTK1A6227
    • NSC211964
    • 2762-36-9
    • SCHEMBL10775641
    • NSC45046
    • 2-Amino-5-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxylic acid
    • NSC-45046
    • 6-Hydroxy-2-imino-5-methyl-2,3-dihydropyrimidine-4-carboxylic acid
    • DTXSID10950284
    • Inchi: 1S/C6H7N3O3/c1-2-3(5(11)12)8-6(7)9-4(2)10/h1H3,(H,11,12)(H3,7,8,9,10)
    • InChI Key: OYSDPNXHUXZZGF-UHFFFAOYSA-N
    • SMILES: O=C1C(C)=C(C(=O)O)N=C(N)N1

Computed Properties

  • Exact Mass: 169.04881
  • Monoisotopic Mass: 169.049
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 316
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -1.2
  • Topological Polar Surface Area: 105?2

Experimental Properties

  • Density: 1.73
  • Boiling Point: 357.8°C at 760 mmHg
  • Flash Point: 170.2°C
  • Refractive Index: 1.706
  • PSA: 104.78
  • LogP: -0.06010
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